Glycoside
GD082676
Name:
NoneFormula:
C18H33O8N2Smiles:
CC(C)(C)OC(=O)N1CC2(C[C@H]([NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CCO2)C1Aglycone:
CC(C)(C)OC(=O)N1CC2(CC([NH3+])CCO2)C1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.89 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 405.47 | Num_heavy_atoms: | 28 |
| TPSA: | 153.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD37045
Formula: C12H23O3N2
Smiles:
CC(C)(C)OC(=O)N1CC2(CC([NH3+])CCO2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 0 |
| MolWt: | 243.33 | Num_heavy_atoms: | 17 |
| TPSA: | 66.41 | NumAromaticRings: | 0 |
